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CHEBI:220891 - Dysidphenol C

ChEBI IDCHEBI:220891
ChEBI NameDysidphenol C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H34O4
Net Charge0
Average Mass374.521
Monoisotopic Mass374.24571
SMILESCOC(=O)c1ccc(O)c(C[C@@H]2[C@@]3(C)CCCC(C)(C)[C@@H]3CC[C@@]2(C)O)c1
InChIInChI=1S/C23H34O4/c1-21(2)10-6-11-22(3)18(21)9-12-23(4,26)19(22)14-16-13-15(20(25)27-5)7-8-17(16)24/h7-8,13,18-19,24,26H,6,9-12,14H2,1-5H3/t18-,19+,22-,23+/m0/s1
InChIKeyRXPHHRPSFMZFFI-JFSTXAPLSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (27109501)
ChEBI Ontology
Outgoing Relation(s)
Dysidphenol C (CHEBI:220891) is a 4-hydroxybenzoate ester (CHEBI:79323)
IUPAC Name 
methyl 3-[[(1R,2R,4aS,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-4-hydroxybenzoate
Manual XrefsDatabases
58197114ChemSpider